Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00005436460 | Gold | 3 |
COMPOUND NPA025672
PROPERTIES
| NPAID | NPA025672 |
|---|---|
| CLUSTER ID | 7763 |
| NODE ID | 5291 |
| NAME | Vatiamide C |
| FORMULA | C31H46ClNO7 |
| MOLECULAR WEIGHT (Da) | 580.1620 |
| ACCURATE MASS (Da) | 579.2963 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Moorea |
| ORIGIN SPECIES | producens ASI6Jul14-2 |
| InChIKey | UOAUHJWVKNXERD-XPKNVKJBSA-N |
| InChI | InChI=1S/C31H46ClNO7/c1-6-7-8-12-24(20-32)15-14-22(2)11-9-10-13-29(34)33-21-31(36)23(3)28(38-5)18-27(40-31)17-26-16-25(37-4)19-30(35)39-26/h1,9,11,19-20,22-23,26-28,36H,7-8,10,12-18,21H2,2-5H3,(H,33,34)/t22-,23?,26?,27?,28?,31?/m0/s1 |
| SMILES | C#CCCCC(=CCl)CC[C@@H](C)C=CCCC(=O)NCC1(O)OC(CC2CC(OC)=CC(=O)O2)CC(OC)C1C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Moss, Nathan A.; Seiler, Grant; Leão, Tiago F.; Castro-Falcón, Gabriel; Gerwick, Lena; Hughes, Chambers C.; Gerwick, William H. Nature's Combinatorial Biosynthesis Produces Vatiamides A–F Angewandte Chemie International Edition 2019 58 (27) 9027-9031. | ||
|---|---|---|---|
| DOI | 10.1002/anie.201902571 | PMID | 31071229 |
